methyl 5-bromanyl-2-[(1H-pyrrol-2-ylcarbonylamino)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(1H-pyrrol-2-ylcarbonylamino)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(1H-pyrrole-2-carbonylamino)sulfamoyl]benzoate CAS Name: 5-bromo-2-[[[oxo(1H-pyrrol-2-yl)methyl]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(1H-pyrrole-2-carbonylamino)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(1H-pyrrole-2-carbonylamino)sulfamoyl]benzoic acid methyl ester Formula: C13H12BrN3O5S MolecularWeight: 402.22048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NNC(=O)C2=CC=CN2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NNC(=O)C2=CC=CN2

InChI

InChI=1S/C13H12BrN3O5S/c1-22-13(19)9-7-8(14)4-5-11(9)23(20,21)17-16-12(18)10-3-2-6-15-10/h2-7,15,17H,1H3,(H,16,18)